SCHEMBL8969151

SCHEMBL8969151

CC(C)OC(=O)C1CSCC1O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8969007 0.81 POLB (0.33) TSHRPOLBNPSR1
SCHEMBL4263557 0.78 CHRM2 (0.34) TSHR
SCHEMBL8969972 0.78 CHRM2 (0.34) TSHR
SCHEMBL29411787 0.77 TSHR (0.40) TSHRPOLBNPSR1
SCHEMBL8969290 0.77 TSHR (0.35) TSHR
SCHEMBL10121177 0.74 TSHR (0.46) TSHRPOLBNPSR1
SCHEMBL1297587 0.74 TSHR (0.46) TSHRPOLBNPSR1
SCHEMBL8970005 0.73 MAPK1 (0.33)
SCHEMBL8970421 0.73 CYP1A2 (0.36) TSHR
SCHEMBL8969484 0.71 ALOX15 (0.33)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0376294-B1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI LTD (JP) 1996-03-13 EP disclosed
US-5370821-A Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-06 US disclosed
US-5269965-A Optically active compounds, liquid crystal compositions comprising said compounds and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES (JP) 1993-12-14 US disclosed
EP-0376294-A1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI, LTD. (JP) 1990-07-04 EP disclosed